8017-3564 Screening compound: [1-(4-fluorophenyl)-4-(hydroxymethyl)-1H-1,2,3-triazol-5-yl]methanol

8017-3564 Screening compound: [1-(4-fluorophenyl)-4-(hydroxymethyl)-1H-1,2,3-triazol-5-yl]methanol
8017-3564 Screening compound: [1-(4-fluorophenyl)-4-(hydroxymethyl)-1H-1,2,3-triazol-5-yl]methanol alternative view

Chemical Structure Depiction of ChemDiv screening compound 8017-3564
[1-(4-fluorophenyl)-4-(hydroxymethyl)-1H-1,2,3-triazol-5-yl]methanol

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

8017-3564

Molecular Formula

C10H10FN3O2 (C10 H10 FN3 O2)

Compound Name

[1-(4-fluorophenyl)-4-(hydroxymethyl)-1H-1,2,3-triazol-5-yl]methanol

IUPAC name

[1-(4-fluorophenyl)-5-(hydroxymethyl)-1H-123-triazol-4-yl]methanol

SMILES

OCc1c(CO)nnn1-c(cc1)ccc1F

InChI

InChI=1S/C10H10FN3O2/c11-7-1-3-8(4-2-7)14-10(6-16)9(5-15)12-13-14/h1-4,15-16H,5-6H2

InChI Key

BSCSIZOVBBYABS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06016176

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

223.21

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

0.228

Distribution Coefficient, logD

0.228

Water Solubility, LogSw

-0.69

Polar Surface Area

61.317

Acid Dissociation Constant (pKa)

15.08

Base Dissociation Constant (pKb)

1.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

8017-3564 in Drug Discovery

Included in Screening Libraries

GABA Library (7115 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Eye
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8017-3564 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8017-3564?
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What is the minimum amount of 8017-3564 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8017-3564
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8017-3564
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 8017-3564 available by request